⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3268739 | 0.78 | ALDH1A1 (0.32) | — | |
| SCHEMBL20804437 | 0.74 | PTGS2 (0.30) | — | |
| SCHEMBL13076640 | 0.72 | KDM1A (0.35) | — | |
| SCHEMBL3267610 | 0.69 | GABRA1 (0.39) | — | |
| SCHEMBL7712089 | 0.69 | DAO (0.45) | — | |
| SCHEMBL3269484 | 0.68 | ACHE (0.39) | — | |
| SCHEMBL7530012 | 0.67 | CYP1A2 (0.40) | — | |
| SCHEMBL24916311 | 0.67 | PKM (0.30) | — | |
| SCHEMBL8630814 | 0.66 | PTGS2 (0.36) | — | |
| SCHEMBL6886890 | 0.66 | HDAC1 (0.37) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1914229-B1 | NOVEL CERCOSPORAMIDE DERIVATIVE | DAIICHI SANKYO CO LTD (JP) | 2010-06-16 | — | — | EP | disclosed |
| US-20090036492-A1 | Novel Cercosporamide Derivative | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2009-02-05 | — | — | US | disclosed |
| CN-101300244-A | Novel cercosporamide derivative | DAIICHI SANKYO CO LTD (JP) | 2008-11-05 | — | — | CN | disclosed |
| EP-1914229-A1 | NOVEL CERCOSPORAMIDE DERIVATIVE | Daiichi Sankyo Company, Limited (JP) | 2008-04-23 | — | — | EP | disclosed |